SCHEMBL7840964

SCHEMBL7840964

CS(=O)(=O)c1ccccc1-c1sc(-c2ccccc2Cl)nc1-c1cccc(F)c1

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 13/20 0.76
PTGS1 P23219 2/20 0.57
L3MBTL1 Q9Y468 1/20 0.42
HSD11B1 P28845 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
MAPT P10636 1/20 0.40
MAPK14 Q16539 1/20 0.38
RORC P51449 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7833474 0.88 PTGS2 (0.76) PTGS2PTGS1MAPT
SCHEMBL7844755 0.88 PTGS2 (0.72) PTGS2PTGS1L3MBTL1HSD11B1RAB9A
SCHEMBL7840959 0.86 PTGS2 (1.00) PTGS2PTGS1MAPK14
SCHEMBL7842480 0.85 PTGS2 (0.74) PTGS2PTGS1L3MBTL1HSD11B1MAPT
SCHEMBL7840353 0.85 PTGS2 (0.63) PTGS2PTGS1L3MBTL1HSD11B1RAB9A
SCHEMBL7843832 0.84 PTGS2 (0.59) PTGS2PTGS1L3MBTL1HSD11B1RAB9A
SCHEMBL7847356 0.84 PTGS2 (0.58) PTGS2PTGS1L3MBTL1HSD11B1RAB9A
SCHEMBL7842503 0.84 PTGS2 (0.58) PTGS2PTGS1L3MBTL1HSD11B1RAB9A
SCHEMBL7842585 0.83 PTGS2 (0.72) PTGS2PTGS1L3MBTL1HSD11B1RAB9A
SCHEMBL7845047 0.83 PTGS2 (0.66) PTGS2PTGS1L3MBTL1HSD11B1RAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1125932-A2 Substituted thiazoles for the treatment of inflammation G.D. SEARLE & CO. (US) 2001-08-22 EP disclosed
US-5668161-A Substituted thiazoles for the treatment of inflammation G.D. SEARLE & CO. (US) 1997-09-16 US disclosed
EP-0772606-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1997-05-14 EP disclosed
WO-1996003392-A1 SUBSTITUTED THIAZOLES FOR THE TREATMENT OF INFLAMMATION G.D. SEARLE & CO. (US) 1996-02-08 WO disclosed